In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2009 | 14 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.30 | 6.58 | -3.55 | 0 | 1 | 0 | 3 | 185.27 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.30 | 8.6 | -36.16 | 1 | 1 | 1 | 4 | 186.278 | 1 | ↓ |